Stage_1/POSCAR output for 592: Bi2WO6_1_opt
Status:
finished
Bi2WO6_1_opt
1.0
5.46815076 0.00000000 0.00000000
0.00000000 5.47499376 0.00000000
0.00000000 0.00000000 16.57348400
Bi W O
8 4 24
Direct
0.02245232 0.01488243 0.07673227 # 1 Bi0
0.97754768 0.51488243 0.92326773 # 2 Bi1
0.47754768 0.51488243 0.07673227 # 3 Bi2
0.52245232 0.01488243 0.92326773 # 4 Bi3
0.97696386 0.02835772 0.42318393 # 5 Bi4
0.02303614 0.52835772 0.57681607 # 6 Bi5
0.52303614 0.52835772 0.42318393 # 7 Bi6
0.47696386 0.02835772 0.57681607 # 8 Bi7
0.49588165 0.99136620 0.24960895 # 9 W8
0.50411835 0.49136620 0.75039105 # 10 W9
0.00411835 0.49136620 0.24960895 # 11 W10
0.99588165 0.99136620 0.75039105 # 12 W11
0.92124813 0.42808824 0.35747707 # 13 O12
0.07875187 0.92808824 0.64252293 # 14 O13
0.57875187 0.92808824 0.35747707 # 15 O14
0.42124813 0.42808824 0.64252293 # 16 O15
0.27396554 0.67402815 0.26969535 # 17 O16
0.72603446 0.17402815 0.73030465 # 18 O17
0.22603446 0.17402815 0.26969535 # 19 O18
0.77396554 0.67402815 0.73030465 # 20 O19
0.78539865 0.73107683 0.22954223 # 21 O20
0.21460135 0.23107683 0.77045777 # 22 O21
0.71460135 0.23107683 0.22954223 # 23 O22
0.28539865 0.73107683 0.77045777 # 24 O23
0.92606126 0.91446651 0.85843823 # 25 O24
0.07393874 0.41446651 0.14156177 # 26 O25
0.57393874 0.41446651 0.85843823 # 27 O26
0.42606126 0.91446651 0.14156177 # 28 O27
0.73840207 0.73625633 0.00064912 # 29 O28
0.26159793 0.23625633 0.99935088 # 30 O29
0.76159793 0.23625633 0.00064912 # 31 O30
0.23840207 0.73625633 0.99935088 # 32 O31
0.76168038 0.74997760 0.50055732 # 33 O32
0.23831962 0.24997760 0.49944268 # 34 O33
0.73831962 0.24997760 0.50055732 # 35 O34
0.26168038 0.74997760 0.49944268 # 36 O35